SCHEMBL9625811

SCHEMBL9625811

C[CH]CCOCCCCCCCCCCCCCCCCCC

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.52
MEN1 O00255 1/20 0.52
THRB P10828 1/20 0.52
KMT2A Q03164 1/20 0.52
MAPT P10636 1/20 0.52
ALDH1A1 P00352 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
CES2 O00748 2/20 0.43
SPHK2 Q9NRA0 1/20 0.41
SPHK1 Q9NYA1 1/20 0.41
TSHR P16473 2/20 0.41
USP2 O75604 1/20 0.41
CES1 P23141 1/20 0.39
GLA P06280 1/20 0.39
HPGD P15428 1/20 0.39
MAPK1 P28482 1/20 0.39
EPHX2 P34913 1/20 0.39
RECQL P46063 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6934840 1.00 HTT (0.52) HTTMEN1THRBKMT2AMAPT
SCHEMBL6936448 1.00 HTT (0.52) HTTMEN1THRBKMT2AMAPT
SCHEMBL6940829 1.00 HTT (0.52) HTTMEN1THRBKMT2AMAPT
SCHEMBL6933555 1.00 HTT (0.52) HTTMEN1THRBKMT2AMAPT
SCHEMBL6936495 1.00 HTT (0.52) HTTMEN1THRBKMT2AMAPT
SCHEMBL6934123 1.00 HTT (0.52) HTTMEN1THRBKMT2AMAPT
SCHEMBL5224444 1.00 HTT (0.52) HTTMEN1THRBKMT2AMAPT
SCHEMBL5222263 0.98 MEN1 (0.48) HTTMEN1THRBKMT2AMAPT
SCHEMBL16057132 0.91 HTT (0.52) HTTMEN1THRBKMT2AMAPT
SCHEMBL4018873 0.91 HTT (0.52) HTTMEN1THRBKMT2AMAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2970346-A1 ACYCLIC NUCLEOSIDE PHOSPHONATE DIESTERS The Regents of the University of California (US) 2016-01-20 EP disclosed
WO-2014143643-A1 ACYCLIC NUCLEOSIDE PHOSPHONATE DIESTERS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA, A CALIFORNIA CORPORATION (US) 2014-09-18 WO disclosed
US-5133973-A Quaternary Ammonium Cationic Surfactants, Antimetabolites MEDICE CHEM.-PHARM. FABRIK PUTTER GMBH & CO. KG (DE) 1992-07-28 US disclosed
US-5118808-A Pharmaceutical preparations MEDICE CHEM.-PHARM. FABRIK PUTTER GMBH & CO. KG (DE) 1992-06-02 US disclosed
US-5112844-A Micelles MEDICE CHEM.-PHARM. FABRIK PUTTER GMBH & CO. KG (DE) 1992-05-12 US disclosed
US-5110929-A Quaternization of pyrazine compounds MEDICE CHAM.-PHARM. FABRIK PUTTER GMBH & CO. KG (DE) 1992-05-05 US disclosed
US-5057518-A Substituted n-alkylpyrimidinium salts for absorbing hydrophobic drugs MEDICE HEM.-PHARM. FABRIK PUTTER GMBH & CO. KG (DE) 1991-10-15 US disclosed
US-5051435-A Micelles of triazolium compounds as cationic surfactants MEDICE CHEM.-PHARM. FABRIK PUTTER GMBH & CO. KG (DE) 1991-09-24 US disclosed
US-5045530-A Conprising a micelle or a vesicle of a cationic teniside based on a hydrophobic alkyl-substituted pyridinium compound and a hydrophobic drug; drug delivery; skin disorders MEDICI CHEM.-PHARM. FABRIK PUTTER GMBH (DE) 1991-09-03 US disclosed
US-4999435-A Cationic Surfactants, Drugs, Immunoassay MEDICE CHEM.-PHARM. FABRIK PUTTER GMBH & CO. KG (DE) 1991-03-12 US disclosed
US-4965357-A CATIONIC TENSIDES, ANTIMETABOLITES MEDICE CHEM.-PHARM. FABRIK PUTTER GMBH & CO. KG (DE) 1990-10-23 US disclosed
US-4894454-A BACTERICIDES MEDICE CHEM.-PHARM. FABRIK, PUTTER GMBH & CO., KG (DE) 1990-01-16 US disclosed
US-4882435-A CATIONIC TENSIDES; THIADIAZOLIUM SALTS MEDICE CHEM.-PHARM. FABRIK (DE) 1989-11-21 US disclosed
US-4877883-A CATIONIC SURFACTANTS MEDICE CHEM.-PHARM. FABRIK PUTTER GMBH & CO. KG (DE) 1989-10-31 US disclosed
US-4874850-A CATIONIC TENSIDES IN MICELLES WITH HYDROPHOBIC PEPTIDES; DRUG DELIVERY MEDICE CHEM.-PHARM. FABRIK PUTTER GMBH & CO. (DE) 1989-10-17 US disclosed
US-4870174-A CATIONIC SURFACTANTS, SMALL CRITICAL MICELLE CONCENTRATIONS MEDICE CHEM.-PHARM. FABRIK (DE) 1989-09-26 US disclosed